Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4630318598
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 35 USD | 90 | 17 working days | Get Quote |
| 5 mg | 35 USD | 95 | 14 working days | Get Quote |
| 10 mg | 41 USD | 95 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
| Name | File |
|---|---|
| SDF | MCULE-4630318598.sdf |
| SMILES | MCULE-4630318598.smiles |
| Standard InChI | MCULE-4630318598.inchi |
| InChIKey | MCULE-4630318598.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867599296 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875757120 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-613851370 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436455735 | Alinda | Building Blocks | 95 | As is | 21 g |
| P-851412099 | AmBeed | On request | N/A | As is | by synthesis |
| P-489241706 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-494437573 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864273227 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590729776 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-492254643 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-4147756 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
| P-454705069 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-851300719 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861555561 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580409075 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862040280 | FluoroChem | General BB | N/A | As is | in stock |
| P-505536593 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-596586657 | Key Organics | Building Blocks | 90 | As is | 1000 mg |
| P-588254822 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852409760 | Matrix Scientific | All | N/A | As is | in stock |
| P-854867004 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-885522947 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-19573671 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-873220770 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611468132 | Toronto Research | In stock | 90 | As is | in stock |
| P-1433584 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.416 g |
| P-886947173 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 200.235 |
| logP | 0.4025 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 60.85 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 55.3308 |
| Atoms | 30 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
